MolSSI Python Data and Scripting
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Integrating Programming and Cheminformatics into the Molecular Science Curriculum: Resources from the Molecular Sciences Software Institute using nanoHUB
Online Presentations | 31 Jan 2024 | Contributor(s): Ashley Ringer McDonald
This presentation will describe open-source curriculum from the Molecular Sciences Software Institute (the MolSSI) to teach programming and cheminformatics using nanoHUB. The MolSSI is an NSF-funded institute that aims to improve software, education, and training in the computational molecular...
Python for Cheminformatics
Tools | 22 Nov 2023 | Contributor(s): Jessica Nash, Ashley Ringer McDonald
Notebooks demonstrating an introduction to cheminformatics using Python
Scientific Data Visualization using Python
Online Presentations | 09 Jun 2022 | Contributor(s): Jessica Nash, Ashley Ringer McDonald
This lecture looks at scientific data visualization using matplotlib, plotly, and visulizing molecular structures using scientific NGLView.
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